sodium; (E)-but-2-enedioate; octadecanoate

Systemtic Name: sodium; (E)-but-2-enedioate; octadecanoate Openeye Name: sodium; (E)-but-2-enedioate; octadecanoate CAS Name: sodium; (E)-2-butenedioate; octadecanoate IUPAC Name: sodium; (E)-but-2-enedioate; octadecanoate Traditional Name: sodium stearate fumarate Formula: C22H37NaO6-2 MolecularWeight: 420.51535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].C(=CC(=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].C(=C/C(=O)[O-])\C(=O)[O-].[Na+]

InChI

InChI=1S/C18H36O2.C4H4O4.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;5-3(6)1-2-4(7)8;/h2-17H2,1H3,(H,19,20);1-2H,(H,5,6)(H,7,8);/q;;+1/p-3/b;2-1+;